2-Bromo-4-fluoro-1,1'-biphenyl
TL;DR: 2-Bromo-4-fluoro-1,1'-biphenyl (CAS 53591-98-3) is a chemical compound with molecular formula C12H8BrF and molecular weight 249.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-bromo-4-fluoro-1-phenylbenzene
Also Known As: 2-Bromo-4-fluoro-1,1'-biphenyl, Flurbiprofen Impurity 48, 2-Bromo-4-fluorobiphenyl, Flurbiprofen Impurity 39, 2-bromo-4-fluoro-1-phenylbenzene
| Molecular Formula | C12H8BrF |
|---|---|
| Molecular Weight | 249.98 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 249.97934 |
| Heavy Atoms | 14 |
| Complexity | 177.0 |
Chemical Identifiers
| CAS Number | 53591-98-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=C(C=C(C=C2)F)Br |
| InChIKey | IGMOABJCVUOIRU-UHFFFAOYSA-N |
Product Overview
2-Bromo-4-fluoro-1,1'-biphenyl (CAS 53591-98-3), with molecular formula C12H8BrF and molecular weight 249.98 g/mol. IUPAC: 2-bromo-4-fluoro-1-phenylbenzene.
Chemical Property Profile of 2-Bromo-4-fluoro-1,1'-biphenyl
Property Insights of 2-Bromo-4-fluoro-1,1'-biphenyl
The XLogP value of 4.8 indicates that 2-Bromo-4-fluoro-1,1'-biphenyl is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 2-Bromo-4-fluoro-1,1'-biphenyl exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Bromo-4-fluoro-1,1'-biphenyl has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-Bromo-4-fluoro-1,1'-biphenyl?
The CAS number of 2-Bromo-4-fluoro-1,1'-biphenyl is 53591-98-3.
What is the molecular formula of 2-Bromo-4-fluoro-1,1'-biphenyl?
The molecular formula of 2-Bromo-4-fluoro-1,1'-biphenyl is C12H8BrF.
What is the molecular weight of 2-Bromo-4-fluoro-1,1'-biphenyl?
The molecular weight of 2-Bromo-4-fluoro-1,1'-biphenyl is 249.98 g/mol.
Where can I buy 2-Bromo-4-fluoro-1,1'-biphenyl?
You can request a quote for 2-Bromo-4-fluoro-1,1'-biphenyl directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Bromo-4-fluoro-1,1'-biphenyl?
Yes, KEHONG BIO provides custom synthesis services for 2-Bromo-4-fluoro-1,1'-biphenyl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.